PUBCHEM-ZINC02496058 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 43 0 0 0 0 0 0 0 0999 V2000 0.3100 1.4850 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -0.0130 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9270 -0.6180 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 -2.1250 1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5380 -2.7300 2.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 -4.2320 2.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 -4.7150 3.6170 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 -6.0480 3.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3360 -6.8410 3.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9310 -6.4560 4.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7240 -5.5000 5.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5590 -5.8750 6.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6090 -7.2040 7.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8240 -8.1650 6.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9770 -7.8120 5.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 -8.7650 4.7050 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0660 -10.1240 4.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6670 -10.7670 5.7920 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 -10.7710 4.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -12.0860 4.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 -12.7660 3.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6970 -12.0220 2.2900 O 0 5 0 0 0 0 0 0 0 0 0 0 1.3580 1.7050 -0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 1.8970 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 2.0010 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 -0.2000 0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3290 -0.4940 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9880 -0.4250 0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -0.1300 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 -2.3190 1.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -2.6130 0.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6030 -2.5380 2.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 -2.2450 3.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2600 -4.4390 2.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5890 -4.7390 1.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 -4.4530 5.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1700 -5.1310 7.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2590 -7.5000 7.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8990 -9.1890 6.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -8.3690 3.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -10.1580 3.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 -12.7130 4.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 -14.0100 3.3230 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 2 0 0 0 0 M CHG 1 22 -1 M END